Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)


Input alignment information:
Query sequenceMLPSSAPPWGPGPHDPAPYSTIAAHNCTAECVDGPTSGSATHNRSTSPRGQPAGGDTASPTPASVEVLGRKTQHRRCSTSPPLKPLMKEAVLARALEKPRCTLASAAMESTGDPPHPSKDSDAETSACIRATCTGSRTRVDHAPPLSLSATVSSVQQHLGMIPQVASSNSASYQASASAPSTPSNRKEASKMQRRSSSAFMSRLPSDTRLRTSLLAAFGVQHAETHGRCDAPSHAPLPVRGSLSMTNSTDVTPVASDTHFRRSVNEGCSTVESHCTATAAASCVVVRAPSGAFRALPHPSIWLNTSLAGIGGVPSFNSSTPSTNASVLKDRHSSGTGTCEVPSESSLLPPFRTSSLDRDGVGAEDCGSEASGTASTSATVEVLHSGDANPVTGDRCSRLPSGRSINTSVSGEVGGFAPDASGTSTAHHTCAESNSSAGGGAELQGAGCSFGWRMFSSLTSQRGGGGGGAPAPSLGIFQSGLYLSMDEGDVSPAPALEVPMTPQSFSTMLLARESSEGAQHPVRAGSATSATTTNGARSSSLAVQEGNDTMLRQSSQQVPIVSQLAEDAWSGGGVAANGIEDWCVDGGSRDSREARTTSTTHTSGVGSHPCLVPGSGSGRCVIGGCCATPLSSFQLLGGSSKQEMPTSALDTDEIPSTPTDISALPYPPPPPLSARRRRQRRACHHCDGGNAVSSNSRVDLETGVIETDTLERARAVSKDGSRAYEIVNGKYVMYDYELGRGSYATVRLCYNLADGHFYAVKVLDRVRLKRRQLGSEAGLCKIDQEIAMMKQVQHKNIIALHEVIRDPSMRYVYLVLELAESREVLSMRDNGDVLPRGDDDGAATAYPEAAAREMVKGLLQALMYIHYLGVAHRDIKPSNVLRTA--DGTVKLCDFGVSVLVGDAPMQLSREGSVAFLAPELLLSSEVEVSRFLTPDDSSLGSTRNKSATHMLADSALATATRNARTTVTSTTTATSATELASTGGPASPKEEGAKWTQRLMSSFAGAALQ--PNARAAASRAPGREIASPGGGAPSAIPPWPSSASLPKRGGGGGAARRASFRTLSLSPCGAAARECAAAIATAAVSPCAGGAAAVTPPTGAYSPSTPAAQPFSDLSKSAGNAPVDLLKADVFALGVTVYTLLLGHLPWRASSAVSQRAAILAEPDPFLRLYKAAYGDAYVGPPQVREACMPRCDVLGSDAIPASSHASTSASGKDGRGASYGTANAELSDGQWAIAAEKDDVVTPAPVTALPCKWRHLSNTGTTPDECTSEQEKCTPTAAKLTAAPQPHRNAPTRSDRNSAQPVGERSTAAAALPRPATQLLAKKATTSESRAPKDLAESPSDDHNPRAPFEAPPPPMPPQQERHLHRFQWRPFMDVVLGSAPIKTATAAGTAITQQAQVTVRHRRGGGGELVDGDLRQTNATTTCIRSRAPAVKMLLSRAATQPRFGSVVQVPHSLAICGDERATWEAQGAAMSGPAVAPPLRPRGPTTTPDQLYPYRGILDVDDDDWMKADESDVVQGMKESAINAEQWVPGSSSDLLRTVPSSAVTGTRSNDSEADSASDCDSSTTTVPCSAAKSTASSLPSDDDEDLESCESIYERLFEMEQPCRAYTVVEHMPLPTMSGTSREISGEAVDFVRSCLCLDPAERRTVFELFRHPWIRGGEGAMLAEAGTSAGSP
1TKI Chain:A ((22-281))--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------EKYMIA-EDLGRGEFGIVHRCVETSSKKTYMAKFVKVKGT---------DQVLVKKEISILNIARHRNILHLHESFES--MEELVMIFEFISGLDIFERINTSA-----------FELNEREIVSYVHQVCEALQFLHSHNIGHFDIRPENIIYQTRRSSTIKIIEFGQARQLKPGDNFRLLFTAPEYYAPEVHQH---DVVSTA-TDMWSLGTLVYVLLSGINPFLAETNQQIIENIM---------------NAEYTFDEEAFKEISI-EAMDFVDRLLVKERKSRMTASEALQHPWLKQK------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 1TKI.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output 		Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1192 -56889 -47.73 -222.22
target 2D structure prediction score : 0.53
Monomeric hydrophicity matching model chain A : 0.56

3D Compatibility (PKB) : -47.73
2D Compatibility (Sec. Struct. Predict.) : 0.53
1D Compatibility (Hydrophobicity) : 0.56
QMean score : 0.263

(partial model without unconserved sides chains):
PDB file : Tito_1TKI.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1TKI-query.scw
PDB file : Tito_Scwrl_1TKI.pdb: